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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H38O8
Molecular Weight 514.6072
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MIOPHYTOCEN B

SMILES

[H][C@@]12C[C@H]3OC(=O)C=C\C=C\[C@@]([H])(OCC\C(C)=C\C(=O)OC[C@@]45CCC(=C)[C@@H](C[C@@]1(O)[C@]34C)[C@@]5([H])O2)[C@@H](C)O

InChI

InChIKey=JNVNAJOQNUCFMY-QZANRFNGSA-N
InChI=1S/C29H38O8/c1-17-10-12-34-21(19(3)30)7-5-6-8-24(31)36-22-14-23-29(33)15-20-18(2)9-11-28(26(20)37-23,27(22,29)4)16-35-25(32)13-17/h5-8,13,19-23,26,30,33H,2,9-12,14-16H2,1,3-4H3/b7-5+,8-6-,17-13+/t19-,20-,21-,22-,23-,26-,27-,28-,29+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MIOPHYTOCEN B
Common Name English
MIOPHYTOCEN A, 9,16-DIDEHYDRO-8,9-DIHYDRO-
Common Name English
16,18:17,20-DIMETHANO-1H,3H,21H-(1,6,12)TRIOXACYCLOOCTADECINO(3,4-D)(1)BENZOPYRAN-3,14(9H)-DIONE, 6,7,16,16A,17,18,19A,20,22,23-DECAHYDRO-17-HYDROXY-9-(1-HYDROXYETHYL)-5,16A-DIMETHYL-21-METHYLENE-, (9R-(4E,9R*(R*),10E,12Z,16R*,16AS*,17R*,18R*,19AR*,20R*,
Systematic Name English
Code System Code Type Description
PUBCHEM
14353782
Created by admin on Sat Dec 16 15:38:20 GMT 2023 , Edited by admin on Sat Dec 16 15:38:20 GMT 2023
PRIMARY
FDA UNII
17P5P956W7
Created by admin on Sat Dec 16 15:38:20 GMT 2023 , Edited by admin on Sat Dec 16 15:38:20 GMT 2023
PRIMARY
CAS
99764-48-4
Created by admin on Sat Dec 16 15:38:20 GMT 2023 , Edited by admin on Sat Dec 16 15:38:20 GMT 2023
PRIMARY https://www.iupac.org/publications/pac/pdf/1989/pdf/6103x0377.pdfPure & Appl. Chem., Vol. 61, No. 3, pp. 377-380, 1989.