MICROCYSTIN-YR

CAS No.
101064-48-6
CCD No.
CCD00107404
Formula
C52 H72 N10 O13
MolWeight
1045.2

Basic Information

Product Name: MICROCYSTIN-YR
CAS: 101064-48-6
English Synonyms: BIOTOXIN ; CYANOBACTERIAL TOXIN ; ALGAE BLOOM TOXIN ; MICROCYSTIN-YR
MDL Number.: MFCD00236437
H bond acceptor: 23
H bond donor: 12
Smile: C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)Cc2ccc(cc2)O)C(=O)O)C)CCCNC(=N)N)/C=C/C(=C/[C@H](C)[C@H](Cc3ccccc3)OC)/C
InChi: InChI=1S/C52H72N10O13/c1-28(25-29(2)41(75-8)27-34-13-10-9-11-14-34)16-21-37-30(3)44(65)59-39(50(71)72)22-23-42(64)62(7)33(6)47(68)56-32(5)46(67)60-40(26-35-17-19-36(63)20-18-35)49(70)61-43(51(73)74)31(4)45(66)58-38(48(69)57-37)15-12-24-55-52(53)54/h9-11,13-14,16-21,25,29-32,37-41,43,63H,6,12,15,22-24,26-27H2,1-5,7-8H3,(H,56,68)(H,57,69)(H,58,66)(H,59,65)(H,60,67)(H,61,70)(H,71,72)(H,73,74)(H4,53,54,55)/b21-16+,28-25+/t29-,30-,31+,32+,37-,38-,39+,40-,41-,43+/m0/s1
InChiKey: InChIKey=OWHASZQTEFAUJC-HVUCWAFBSA-N

Property

Physical Property: FLASHPOINT: 11 DEG C
FLASHPOINT: 51.8 DEG F
Comments: CONCENTRATION: 10 MICROGRAM/ML IN METHANOL
FOR ENVIRONMENTAL ANALYSIS
FORM: SOLUTION
RIDADR: UN 1230 3/PG 2
STORAGE TEMPERATURE: -20 DEG C
UNSPSC: 12352100
WGK: 1
Specification: ANALYTICAL STANDARD
Concentration: 10 MICROGRAM/ML IN METHANOL

Safety information

Symbol: GHS06 GHS06
Signal word: Danger
Hazard statements: H300-H310-H315-H317-H319-H330-H335
Precautionary statements: P260-P264-P280-P284-P301 + P310-P302 + P350
hazard symbol: T+
Risk Code: R:26/27/28-36/37/38-43
Safe Code: S:26-36/37/39-45
WGK Germany: 3

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