42-O-FORMYL RAPAMYCIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C52H79NO14
Molecular Weight	942.182
Optical Activity	UNSPECIFIED
Defined Stereocenters	15 / 15
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1(CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O1)OC)[C@H](C)C[C@@H]4CC[C@@H](OC=O)[C@H](C4)OC

InChI

InChIKey=IUPNCBWADBCXHV-BYPOCAKSSA-N

InChI=1S/C52H79NO14/c1-31-16-12-11-13-17-32(2)43(62-8)28-39-21-19-37(7)52(61,67-39)49(58)50(59)53-23-15-14-18-40(53)51(60)66-44(34(4)26-38-20-22-42(65-30-54)45(27-38)63-9)29-41(55)33(3)25-36(6)47(57)48(64-10)46(56)35(5)24-31/h11-13,16-17,25,30-31,33-35,37-40,42-45,47-48,57,61H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12+,32-17+,36-25+/t31-,33-,34-,35-,37-,38+,39+,40+,42-,43+,44+,45+,47-,48+,52-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C52H79NO14
Molecular Weight	942.182
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:16:15 UTC 2023` Edited by `admin` on `Sat Dec 16 11:16:15 UTC 2023`
Record UNII	SA2YXL34JA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

42-O-FORMYL RAPAMYCIN

Common Name

English

EVEROLIMUS EP IMPURITY E

Common Name

English

EVEROLIMUS IMPURITY E [EP IMPURITY]

Common Name

English

23,27-EPOXY(7E,15E,17E,19E)-3H-PYRIDO(2,1-C)(1,4)OXAAZACYCLOHENTRIACONTINE-1,5,11,28,29(4H,6H,31H)-PENTONE, 3-((1R)-2-((1S,3R,4S)-4-(FORMYLOXY)-3-METHOXYCYCLOHEXYL)-1-METHYLETHYL)-9,10,12,13,14,21,22,23,24,25,26,27,32,33,34,34A-HEXADECAHYDRO-9,27-DIHYDRO

Systematic Name

English

Code System Code Type Description

CAS

1237826-25-3

Created by admin on Sat Dec 16 11:16:15 UTC 2023 , Edited by admin on Sat Dec 16 11:16:15 UTC 2023

PRIMARY

FDA UNII

SA2YXL34JA

Created by admin on Sat Dec 16 11:16:15 UTC 2023 , Edited by admin on Sat Dec 16 11:16:15 UTC 2023

PRIMARY

PUBCHEM

162623797

Created by admin on Sat Dec 16 11:16:15 UTC 2023 , Edited by admin on Sat Dec 16 11:16:15 UTC 2023

PRIMARY

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EVEROLIMUS

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