U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C33H28O9
Molecular Weight 568.57
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RUBICORDIFOLIN

SMILES

[H][C@]12C[C@@](C)(OC3=C4C=CC=CC4=C(O)C(C(=O)O[C@H]1C(C)(C)O)=C23)C5=CC6=C(O5)C7=CC=CC=C7C(O)=C6C(=O)OC

InChI

InChIKey=ZDZRMYBQJYWXBR-CXUYDDCUSA-N
InChI=1S/C33H28O9/c1-32(2,38)29-20-14-33(3,42-28-18-12-8-6-10-16(18)26(35)24(22(20)28)31(37)41-29)21-13-19-23(30(36)39-4)25(34)15-9-5-7-11-17(15)27(19)40-21/h5-13,20,29,34-35,38H,14H2,1-4H3/t20-,29-,33-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
RUBICORDIFOLIN
Common Name English
methyl 5-hydroxy-2-[(12R,13R,15R)-8-hydroxy-12-(2-hydroxypropan-2-yl)-15-methyl-10-oxo-11,16-dioxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8-pentaen-15-yl]benzo[g][1]benzofuran-4-carboxylate
Systematic Name English
NAPHTHO(1,2-B)FURAN-4-CARBOXYLIC ACID, 5-HYDROXY-2-((2R,3AR,4R)-2,3,3A,6-TETRAHYDRO-7-HYDROXY-4-(1-HYDROXY-1-METHYLETHYL)-2-METHYL-6-OXO-4H-BENZO(H)PYRANO(3,4,5-DE)-1-BENZOPYRAN-2-YL)-, METHYL ESTER, REL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID601030377
Created by admin on Sat Dec 16 17:35:57 GMT 2023 , Edited by admin on Sat Dec 16 17:35:57 GMT 2023
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FDA UNII
ZCR8BY5KW4
Created by admin on Sat Dec 16 17:35:57 GMT 2023 , Edited by admin on Sat Dec 16 17:35:57 GMT 2023
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WIKIPEDIA
Rubicordifolin
Created by admin on Sat Dec 16 17:35:57 GMT 2023 , Edited by admin on Sat Dec 16 17:35:57 GMT 2023
PRIMARY
PUBCHEM
11786393
Created by admin on Sat Dec 16 17:35:57 GMT 2023 , Edited by admin on Sat Dec 16 17:35:57 GMT 2023
PRIMARY
CAS
849699-55-4
Created by admin on Sat Dec 16 17:35:57 GMT 2023 , Edited by admin on Sat Dec 16 17:35:57 GMT 2023
PRIMARY