
无数据
无数据
无数据
| CAS Number | 303-45-7 |
| Catalog Number | AG003D6Q(AGN-PC-0R5PT5) |
| Chemical Name | Gossypol solution |
| IUPAC Name | 7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde |
| InChI | InChI=1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3 |
| InChI Key | QBKSWRVVCFFDOT-UHFFFAOYSA-N |
| MDL Number | MFCD00017352 |
| Molecular Formula | C30H30O8 |
| Molecular Weight | 518.5544 |
| SMILES | O=CC1=C(O)C(O)=C(C2=CC(=C(C(O)=C12)C3=C(O)C4=C(C=O)C(O)=C(O)C(=C4C=C3C)C(C)C)C)C(C)C |
| Synonyms | Dipotassium Salt, Gossypol,
Gossypol,
Gossypol Dipotassium Salt,
Gossypol Sodium Salt,
Gossypol, (+)-Isomer,
Gossypol, (+-)-Isomer,
Gossypol, (-)-Isomer,
Sodium Salt, Gossypol,
gossypol,
303-45-7,
(-)-Gossypol,
90141-22-3,
Pogosin,
(+)-Gossypol,
Tash 1,
(R)-(-)-Gossypol,
(R)-Gossypol,
racemic-Gossypol,
(+-)-Gossypol,
(+/-)-Gossypol,
NSC 56817,
CCRIS 2689,
AT101,
NSC56817,
BL 193,
NSC 624336,
BRN 1917878,
CHEMBL51483,
AI3-22957,
1,1',6,6',7,7'-Hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-[2,2'-binaphthalene]-8,8'-dicarbaldehyde,
20300-26-9,
2,2'-bi[8-Formyl-1,6,7-trihydroxy-5-isopropyl-3-methylnaphthalene],
2,2'-Bis(1,6,7-trihydroxy-3-methyl-5-isopropyl-8-aldehydonaphthalene),
MFCD00017352,
NSC624336,
Gossypol acetate,
7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde,
NCGC00016423-03,
CAS-303-45-7,
ST065835,
8-Formyl-1,6,7-trihydroxy-5-isopropyl-3-methyl-2,2'-bisnaphthalene,
DSSTox_CID_3110,
Gossypol acetic acid,
DSSTox_RID_76879,
DSSTox_GSID_23110,
(2,2'-Binaphthalene)-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-, (-)-,
(2,2'-Binaphthalene)-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-, (+)-,
[2,2'-Binaphthalene]-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-,
4-08-00-03754 (Beilstein Handbook Reference),
7-[8-formyl-1,6,7-trihydroxy-3-methyl-5-(propan-2-yl)naphthalen-2-yl]-2,3,8-trihydroxy-6-methyl-4-(propan-2-yl)naphthalene-1-carbaldehyde,
No Fertil,
(2,2'-Binaphthalene)-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahyd,
(2,2'-Binaphthalene)-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-,
(2,2'-Binaphthalene)-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-,
7-(8-formyl-1,6,7-trihydroxy-5-isopropyl-3-methyl-2-naphthyl)-2,3,8-trihydroxy-4-isopropyl-6-methyl-naphthalene-1-carbaldehyde,
7-[8-formyl-1,6,7-trihydroxy-3-methyl-5-(methylethyl)(2-naphthyl)]-2,3,8-trihy droxy-6-methyl-4-(methylethyl)naphthalenecarbaldehyde,
Gossypol Sodium Salt,
Gissypol, (R)-,
NSC-19048,
Sodium Salt, Gossypol,
Gossypol, (+)-Isomer,
Gossypol, (-)-Isomer,
SR-01000597521,
Gossypol Dipotassium Salt,
UNII-XNA7DR63CQ,
Gossypol, (+-)-Isomer,
Dipotassium Salt, Gossypol,
UNII-8DY2X8LXW4,
ssypol,
UNII-KAV15B369O,
Gossyol,
HSDB 7872,
Gossypol, 4,
Prestwick_1031,
Gossypol, (R)-,
Gossypol, (S)-,
Spectrum_000359,
Spectrum_001521,
Tocris-1964,
SpecPlus_000602,
AC1Q2QPP,
acetic acid;7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde,
Prestwick0_000677,
Prestwick1_000677,
Prestwick2_000677,
Prestwick3_000677,
Spectrum2_001472,
Spectrum2_001624,
Spectrum3_001102,
Spectrum3_001516,
Spectrum4_000846,
Spectrum4_001931,
Spectrum5_000693,
Spectrum5_001035,
2,2'-bis[8-formyl-1,6,7-trihydroxy-5-isopropyl-3-methylnaphthalene],
Gossypol from cotton seeds,
XNA7DR63CQ,
AT-101/GOSSYPOL,
UPCMLD-DP103,
NCIMech_000271,
AC1L1G2Z,
cid_3503,
SCHEMBL3939,
8DY2X8LXW4,
BSPBio_000773,
BSPBio_002804,
BSPBio_003191,
KBioGR_001451,
KBioGR_002303,
KBioSS_000839,
KBioSS_002001,
MLS000028490,
DivK1c_000173,
DivK1c_006698,
SPECTRUM1504019,
SPBio_001423,
SPBio_001687,
SPBio_002694,
BPBio1_000851,
cid_227456,
GTPL4204,
KAV15B369O,
DTXSID5023110,
UPCMLD-DP103:001,
UPCMLD-DP103:002,
BDBM23223,
BDBM46555,
CTK8G0094,
KBio1_000173,
KBio1_001642,
KBio2_000839,
KBio2_002001,
KBio2_003407,
KBio2_004569,
KBio2_005975,
KBio2_007137,
KBio3_002024,
KBio3_002691,
EX-A068,
NINDS_000173,
QBKSWRVVCFFDOT-UHFFFAOYSA-N,
HMS1570G15,
HMS2097G15,
HMS3262J15,
HMS3268O22,
HMS3651C18,
HMS3677L10,
BCP03607,
ZINC3775575,
Tox21_110434,
Tox21_500847,
BN0226,
CCG-35400,
NSC-56817,
NSC726190,
NSC728875,
SBB012338,
STK063457,
AKOS002140475,
Tox21_110434_1,
BCP9000332,
CS-2106,
DB13044,
LMPR0103330002,
LP00847,
MCULE-2539927675,
NSC-624336,
NSC-726190,
NSC-728875,
PXT0004725,
SB17342,
IDI1_000173,
KS-0000183E,
SMP2_000170,
NCGC00016423-01,
NCGC00016423-02,
NCGC00016423-04,
NCGC00016423-05,
NCGC00016423-06,
NCGC00016423-07,
NCGC00016423-08,
NCGC00016423-09,
NCGC00016423-10,
NCGC00016423-14,
NCGC00016423-15,
NCGC00025331-01,
NCGC00025331-02,
NCGC00025331-03,
NCGC00025331-04,
NCGC00025331-06,
NCGC00025331-07,
NCGC00261532-01,
(2,2-Binaphthalene)-8,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-, (+-)-,
4CA-0193,
AC-20251,
AC-30274,
AJ-45571,
AK148510,
AN-44192,
BC216252,
HY-13407,
LS-43993,
LS-43994,
LS-43996,
LS-43997,
NCI60_001588,
NCI60_004391,
SC-79036,
SMR000058386,
BCP0726000183,
AB00052921,
FT-0631917,
N2135,
ST24036539,
SW197103-2,
V0195,
A15004,
C07667,
S-7805,
156767-EP2284178A2,
156767-EP2284179A2,
303G457,
C-23051,
J-017920,
SR-01000597521-1,
SR-01000597521-5,
SR-01000597521-6,
(+/-)-Gossypol from cotton seeds, >=95% (HPLC),
BRD-K19295594-001-06-9,
BRD-K19295594-001-10-1,
BRD-K19295594-015-02-8,
8-Formyl-1,7-trihydroxy-5-isopropyl-3-methyl-2,2'-bisnaphthalene,
(+/-)-2,2'-bis(8-Formyl-1,6,7-trihydroxy-5-isopropyl-3-methylnaphthalene),
(-)-2,2'-Bis(1,6,7-trihydroxy-3-methyl-5-isopropyl-8-aldehydonaphthalene),
(2,8'-dicarboxaldehyde, 1,1',6,6'7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-,
[2,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-,
(+)1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-dicarboxaldehyde,
(-)-1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-[2,2'-binaphthalene]-8,8'-dicarboxaldehyde,
(-)-1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-dicarboxaldehyde,
[2,2'-Binaphthalene]-8,8'-dicarboxaldehyde,1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-, (2R)-,
[2,8'-dicarboxaldehyde, 1,1',6,6',7,7'- hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-, (2R)-,
[2,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1- methylethyl)-,
[2,8'-dicarboxaldehyde, 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-,
1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-[2,2'-binaphthalene]-8,8'-dicarboxaldehyde,
1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-2,2'-binaphthalene-8,8'-dicarbaldehyde,
1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-dicarboxaldehyde,
1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-2,2'-binaphthalene-8,8'-dicarbaldehyde,
1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-dicarbaldehyde,
1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthyl-8,8'-dicarbaldehyde,
1,1',6,6'-Tetrahydroxy-3,3'-dimethyl-5,5'-diisopropyl-8,8'-bis(hydroxymethylene)-2,2'-binaphthalene-7,7'(8H,8'H)-dione,
7-(8-Formyl-1,6,7-trihydroxy-3-methyl-5-(methylethyl)(2-naphthyl))-2,3,8-trihydroxy-6-methyl-4-(methylethyl)naphthalenecarbaldehyde,
acetic acid;7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-yl-2-naphthalenyl)-2,3,8-trihydroxy-6-methyl-4-propan-2-yl-1-naphthalenecarboxaldehyde,
acetic acid;7-(8-formyl-1,6,7-trihydroxy-5-isopropyl-3-methyl-2-naphthyl)-2,3,8-trihydroxy-4-isopropyl-6-methyl-naphthalene-1-carbaldehyde,
ethanoic acid;7-[8-methanoyl-3-methyl-1,6,7-tris(oxidanyl)-5-propan-2-yl-naphthalen-2-yl]-6-methyl-2,3,8-tris(oxidanyl)-4-propan-2-yl-naphthalene-1-carbaldehyde,
Pogosin|||AT-101|||7-(8-Formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde,
;ssypol,
gosipol,
gossypol sodium,
gossypol potassium,
gossypol dipotassium,
( )-Gossypol,
(S)-(+)-Gossypol,
Gossypol Acetic acid salt,
AT 101,
AT-101,
D0Z0HH,
3-Chloro-1,2-propanediol,
3-Chloropropane-1,2-diol,
cc-703,
MLS000028630,
C30H30O8,
CID3503,
AR-1D1203,
ACN-035534,
C30-H30-O8,
SMR000058743,
A3196,
A10435,
A11202,
D006072,
Gossypol, 98%, from Gossypium Linn. - 100MG 100mg,
1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,,
96-24-2,
(R)-1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-[2,2'-binaphthalene]-8,8'-dicarboxaldehyde,
40112-23-0,
|
| Complexity | 780 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 518.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 38 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 6 |
| Isotope Atom Count | 0 |
| Molecular Weight | 518.562g/mol |
| Monoisotopic Mass | 518.194g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 156A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 6.9 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302 |
| Packing Group | |
| Precautionary statements | P280-P305+P351+P338 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

