(S,S)-ICG 001
Product Code
TRC-I163800-250MG
CAS Number
Product Format
Neat
Molecular Formula
C33 H32 N4 O4
Molecular Weight
548.632
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
(S,S)-ICG 001
CAS Number
847591-62-2
Molecular Formula
C33 H32 N4 O4
Molecular Weight
548.632
Accurate Mass
548.242
SMILES
Oc1ccc(C[C@@H]2N3[C@H](CN(Cc4cccc5ccccc45)C2=O)N(CCC3=O)C(=O)NCc6ccccc6)cc1
InChI
InChI=1S/C33H32N4O4/c38-27-15-13-23(14-16-27)19-29-32(40)35(21-26-11-6-10-25-9-4-5-12-28(25)26)22-30-36(18-17-31(39)37(29)30)33(41)34-20-24-7-2-1-3-8-24/h1-16,29-30,38H,17-22H2,(H,34,41)/t29-,30+/m0/s1
IUPAC
(6S,9aS)-N-benzyl-6-[(4-hydroxyphenyl)methyl]-8-(naphthalen-1-ylmethyl)-4,7-dioxo-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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