Hexahydrofuro[2,3-b]furan-3-yl N-[(1S,2R)-2-hydroxy-3-[[[4-[[(methylamino)carbonyl]amino]phenyl]sulfonyl](2-methylpropyl)amino]-1-(phenylmethyl)propyl]carbamate, (3R,3aS,6aR)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H40N4O8S
Molecular Weight	604.715
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Hexahydrofuro[2,3-b]furan-3-yl N-[(1S,2R)-2-hydroxy-3-[[[4-[[(methylamino)carbonyl]amino]phenyl]sulfonyl](2-methylpropyl)amino]-1-(phenylmethyl)propyl]carbamate, (3R,3aS,6aR)-

Structure Search

SMILES

CNC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](CC2=CC=CC=C2)NC(=O)O[C@H]3CO[C@H]4OCC[C@@H]34

InChI

InChIKey=INKPXMCKPAXLEW-UIPNDDLNSA-N

InChI=1S/C29H40N4O8S/c1-19(2)16-33(42(37,38)22-11-9-21(10-12-22)31-28(35)30-3)17-25(34)24(15-20-7-5-4-6-8-20)32-29(36)41-26-18-40-27-23(26)13-14-39-27/h4-12,19,23-27,34H,13-18H2,1-3H3,(H,32,36)(H2,30,31,35)/t23-,24-,25+,26-,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H40N4O8S
Molecular Weight	604.715
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:54:07 GMT 2025` Edited by `admin` on `Wed Apr 02 20:54:07 GMT 2025`
Record UNII	MS976L97MN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(3R,3aS,6aR)-Hexahydrofuro[2,3-b]furan-3-yl N-[(1S,2R)-2-hydroxy-3-[[[4-[[(methylamino)carbonyl]amino]phenyl]sulfonyl](2-methylpropyl)amino]-1-(phenylmethyl)propyl]carbamate

Preferred Name

English

Hexahydrofuro[2,3-b]furan-3-yl N-[(1S,2R)-2-hydroxy-3-[[[4-[[(methylamino)carbonyl]amino]phenyl]sulfonyl](2-methylpropyl)amino]-1-(phenylmethyl)propyl]carbamate, (3R,3aS,6aR)-

Systematic Name

English

Carbamic acid, N-[(1S,2R)-2-hydroxy-3-[[[4-[[(methylamino)carbonyl]amino]phenyl]sulfonyl](2-methylpropyl)amino]-1-(phenylmethyl)propyl]-, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl ester

Systematic Name

English

Code System Code Type Description

CAS

1451010-37-9

Created by admin on Wed Apr 02 20:54:07 GMT 2025 , Edited by admin on Wed Apr 02 20:54:07 GMT 2025

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FDA UNII

MS976L97MN

Created by admin on Wed Apr 02 20:54:07 GMT 2025 , Edited by admin on Wed Apr 02 20:54:07 GMT 2025

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PUBCHEM

102192843

Created by admin on Wed Apr 02 20:54:07 GMT 2025 , Edited by admin on Wed Apr 02 20:54:07 GMT 2025

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