Delta6,7-baccatin iii

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Catalog Number
ACM158830503
Product Name
Delta6,7-baccatin iii
CAS
158830-50-3
Category
Heterocyclic Organic Compound
Synonyms
(2aR,4aR,6R,9S,11S,12S,12aR,12bS)-6,12b-Bis(acetyloxy)-12-(benzoyloxy)-1,2a,4a,6,9,10,11,12,12a,12b-decahydro-9,11-dihydroxy-4a,8,13,13-tetramethyl-7,11-methano-5H-cyclodeca[3,4]benz[1,2-b]oxet-5-one;
IUPAC Name
6,7-dehydro-baccatin III
Molecular Weight
568.61
Molecular Formula
C31H36O10
Canonical SMILES
CC1=C2C(C(=O)C3(C=CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)C)OC(=O)C
InChI Key
GKORGTAVTDVIOM-KSGSGGQMSA-N
Appearance
Off-White Solid
Exact Mass
568.23100
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