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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H34O8
Molecular Weight 522.5862
Optical Activity UNSPECIFIED
Additional Stereochemistry Yes
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0
Stereo Comments AXIAL, R

SHOW SMILES / InChI
Structure of BENZOYLGOMISIN H

SMILES

COC1=CC2=C(C(OC(=O)C3=CC=CC=C3)=C1OC)C4=C(OC)C(OC)=C(OC)C=C4C[C@](C)(O)[C@@H](C)C2

InChI

InChIKey=AZQOQICAWOAGEN-ZOKDDAQRSA-N
InChI=1S/C30H34O8/c1-17-13-19-14-21(33-3)26(36-6)28(38-29(31)18-11-9-8-10-12-18)23(19)24-20(16-30(17,2)32)15-22(34-4)25(35-5)27(24)37-7/h8-12,14-15,17,32H,13,16H2,1-7H3/t17-,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H34O8
Molecular Weight 522.5862
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:18:29 GMT 2023
Edited
by admin
on Sat Dec 16 10:18:29 GMT 2023
Record UNII
LFV2GVE8UO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOYLGOMISIN H
Common Name English
DIBENZO(A,C)CYCLOOCTENE-1,7-DIOL, 5,6,7,8-TETRAHYDRO-2,3,10,11,12-PENTAMETHOXY-6,7-DIMETHYL-, 1-BENZOATE, (6S,7S,12AR)-
Systematic Name English
Code System Code Type Description
PUBCHEM
14992069
Created by admin on Sat Dec 16 10:18:29 GMT 2023 , Edited by admin on Sat Dec 16 10:18:29 GMT 2023
PRIMARY
CAS
66056-23-3
Created by admin on Sat Dec 16 10:18:29 GMT 2023 , Edited by admin on Sat Dec 16 10:18:29 GMT 2023
PRIMARY
EPA CompTox
DTXSID401316581
Created by admin on Sat Dec 16 10:18:29 GMT 2023 , Edited by admin on Sat Dec 16 10:18:29 GMT 2023
PRIMARY
FDA UNII
LFV2GVE8UO
Created by admin on Sat Dec 16 10:18:29 GMT 2023 , Edited by admin on Sat Dec 16 10:18:29 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT