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AG0035UZ

38748-32-2 | Triptolide

AG0035UZ

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CAS Number	38748-32-2
Catalog Number	AG0035UZ(AGN-PC-0RH9N3)
Chemical Name	Triptolide
IUPAC Name	(1S,2S,4S,5S,7R,8R,9S,11S,13S)-8-hydroxy-1-methyl-7-propan-2-yl-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-en-17-one
InChI	InChI=1S/C20H24O6/c1-8(2)18-13(25-18)14-20(26-14)17(3)5-4-9-10(7-23-15(9)21)11(17)6-12-19(20,24-12)16(18)22/h8,11-14,16,22H,4-7H2,1-3H3/t11-,12-,13-,14-,16+,17-,18-,19+,20+/m0/s1
InChI Key	DFBIRQPKNDILPW-CIVMWXNOSA-N
MDL Number	MFCD00210565
Molecular Formula	C20H24O6
Molecular Weight	360.4010
NSC Number	163062
SMILES	CC(C)[C@]12[C@H]([C@H]3[C@]4([C@@]5(C)CCC6=C(COC6=O)C5C[C@H]7[C@]4([C@@H]1O)O7)O3)O2
UNII	19ALD1S53J
Synonyms	PG490, triptolide, triptolide, 38748-32-2, Triptolid, PG490, NSC 163062, UNII-19ALD1S53J, 19ALD1S53J, CHEBI:9747, CHEMBL463763, C20H24O6, MFCD00210565, PG-490, CPD000466307, Triptolide (PG490), Triptolide, Tripterygium wilfordii, (-)-Triptolide, PG 490, SMR000466307, Trisoxireno(4b,5:6,7:8a,9)phenanthro(1,2-c)furan-1(3H)-one, 3b,4,4a,6,6a,7a,7b,8b,9,10-decahydro-6-hydroxy-8b-methyl-6a-(1-methylethyl)-, (3bS,4aS,5aS,6R,6aR,7aS,7bS,8aS,8bS)-, NSC163062, Triptolide, 1, Triptolide(PG490)/, AC1Q6AXN, BSPBio_001595, KBioGR_000315, KBioSS_000315, (3bs,4as,5as,6r,6ar,7as,7bs,8as,8bs)-6-hydroxy-6a-isopropyl-8b-methyl-3b,4,4a,6,6a,7a,7b,8b,9,10-decahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1(3h)-one, MLS000759410, MLS001424107, MLS006010844, SCHEMBL413634, DTXSID5041144, KBio2_000315, KBio2_002883, KBio2_005451, KBio3_000629, KBio3_000630, DFBIRQPKNDILPW-CIVMWXNOSA-N, s493, Bio2_000315, Bio2_000795, HMS1361P17, HMS1791P17, HMS1989P17, HMS2051N13, HMS3402P17, AC1L3342, TPL, ZINC8234271, ABP000271, BDBM50241049, s3604, AKOS022168197, AM84923, CCG-100957, CS-0286, DB12025, NC00207, NSC-163062, IDI1_034065, NCGC00163411-01, NCGC00163411-02, NCGC00163411-03, NCGC00163411-07, (3bS,4aS,5aS,6R,6aR,7aS,7bS,8aS,8bS)-3b,4,4a,6,6a,7a,7b,8b,9,10-Decahydro-6-hydroxy-8b-methyl-6a-(1-methylethyl)-trisoxireno[4b,5:6,7:8a,9]phenanthro[1,2-c]furan-1(3H)-one, AN-10373, HY-32735, NCI60_001223, PG490;PG 490;PG-490, SAM001246553, SC-14019, LS-157717, C09204, W-2654, AB00639938-06, AB00639938-08, 748T322, Q-100450, BRD-K39484304-001-02-5, BRD-K39484304-001-06-6, BRD-K39484304-001-16-5, (3bS,4aS,5aS,6R,6aR,7aS,7bS,8aS,8bS)-3b,4,4a,6,6a,7a,7b,8b,9,10-Decahydro-6-hydroxy-8b-methyl-6a-(1-methylethyl)trisoxireno[4b,5:6,7:8a,9]phenanthro[1,2-c]furan-1(3H)-one, (3bS,4aS,5aS,6R,6aR,7aS,7bS,8aS,8bS)-6-hydroxy-8b-methyl-6a-(propan-2-yl)-3b,4,4a,6,6a,7a,7b,8b,9,10-decahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1(3H)-one, (5bS,6aS,7aS,8R,8aR,9aS,9bS,10aS,10bS)-8-hydroxy-8a-isopropyl-10b-methyl-2,5,5b,6,6a,8,8a,9a,9b,10b-decahydrotris(oxireno)[2',3':4b,5;2'',3'':6,7;2''',3''':8a,9]phenanthro[1,2-c]furan-3(1H), (5bS,6aS,7aS,8R,8aR,9aS,9bS,10aS,10bS)-8-hydroxy-8a-isopropyl-10b-methyl-2,5,5b,6,6a,8,8a,9a,9b,10b-decahydrotris(oxireno)[2',3':4b,5;2'',3'':6,7;2''',3''':8a,9]phenanthro[1,2-c]furan-3(1H)-one, Trisoxireno(4b,5:6,7:8a,9)phenanthro(1,2-c)furan-1(3H)-one,3b,4,4a,6,6a,7a,7b,8b,9,10-decahydro-6-hydroxy-8b-methyl-6a-(1-methylethyl)-,(3bS,4aS,5aS,6R,6aR,7aS,7bS,8aS,8bS)-, Trisoxireno[4b,7:8a,9]phenanthro[1,2-c]furan-(3H)-one, 3b,4,4a,6,6a,7a,7b,8b,9,10-decahydro-6-hydroxy-8b-methyl-6a-(1-methylethyl)-, [3bR-(3b.alpha.,4a.alpha.,5aS,6.beta.,6a.beta.,7a.beta.,7b.alpha.,8aS,8b.beta.)]-, Trisoxireno[4b,7:8a,9]phenanthro[1,2-c]furan-1(3H)-one, 3b,4,4a,6,6a,7a,7b,8b,9,10-decahydro-6-hydroxy-8b-methyl-6a-(1-methylethyl)-, [3bR-(3b.alpha.,4a.alpha.,5aS,6.beta.,6a.beta.,7a.beta.,7b.alpha.,8aS,8b.beta.)]-, -one, Triptolide (9CI), D0I6LH, KST-1A4632, AR-1A4117, CID107985, ACN-035487, C20-H24-O6, A2001, T2899, C001899, Triptolide, 98%, from Tripterygium - 10MG 10mg, 40598-48-9, 38647-11-9,

Complexity	819
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	9
Defined Bond Stereocenter Count	0
Exact Mass	360.157g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	360.406g/mol
Monoisotopic Mass	360.157g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	84.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code	UN 2811

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CERTIFICATE OF ANALYSIS

Chemical Name:	Batch Number:
Chemical Structure:	CAS Registry No:
	Product ID:
	Manufacture Date:
	Storage Temperature:
	Formula:
	Molecular Weight:
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Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited