BU-72

Details

Stereochemistry	MIXED
Molecular Formula	C28H32N2O2
Molecular Weight	428.5659
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12N[C@H](C3=CC=CC=C3)C4(C)CC5(C=C[C@]14OC)[C@@]6([H])CC7=CC=C(O)C=C7[C@@]25CCN6C

InChI

InChIKey=RGJHUVJQGAAZLK-DIZBDODISA-N

InChI=1S/C28H32N2O2/c1-25-17-26-11-12-28(25,32-3)24(29-23(25)18-7-5-4-6-8-18)27(26)13-14-30(2)22(26)15-19-9-10-20(31)16-21(19)27/h4-12,16,22-24,29,31H,13-15,17H2,1-3H3/t22-,23-,24+,25?,26?,27+,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H32N2O2
Molecular Weight	428.5659
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	5 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:11:22 UTC 2023` Edited by `admin` on `Sat Dec 16 18:11:22 UTC 2023`
Record UNII	KVN8RP2FQX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BU-72

Code

English

6,11B-(IMINOETHANO)-3,5A-METHANO-1H-NAPHTH(2,1-G)INDOL-10-OL, 2,3,3A,6,7,11C-HEXAHYDRO-3A-METHOXY-3,14-DIMETHYL-2-PHENYL-, (2R,3S,3AR,5AR,6R,11BR,11CS)-

Systematic Name

English

BU 72

Code

English

Code System Code Type Description

EPA CompTox

DTXSID001336686