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Molecule Identifiers
Molecular Properties

ID: 43

SMILES:
C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 314.469

InChIKey:
CYQFCXCEBYINGO-UHFFFAOYSA-N

ID: 44

SMILES:
COc1c(CCCCC)c2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2

Pathway: Polyketides

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 346.511

InChIKey:
QYMXVEJKQRAESF-UHFFFAOYSA-N

ID: 45

SMILES:
C1(=O)c2c(c(C(=O)O)c(CCCCC)cc2O)OC(C)(CCC=C(C)C)C1O

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 390.476

InChIKey:
PXASKMNNJRVAAC-UHFFFAOYSA-N

ID: 46

SMILES:
Oc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 260.333

InChIKey:
WRBRAMOWKIFTPD-UHFFFAOYSA-N

ID: 47

SMILES:
C=C(C)C1CCC(C)=CC1c1c(O)ccc(CCC(=O)O)c1

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 300.398

InChIKey:
XMEKZWSHAHWCBY-UHFFFAOYSA-N

ID: 48

SMILES:
C(c1c(CCCCC)cc2c(c1O)OC(C)(C)C1C2C=C(C(=O)OC)CC1)=O

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 386.488

InChIKey:
ANVRRRXSKFJJOU-UHFFFAOYSA-N

ID: 49

SMILES:
C1CC2=C(OC(C)(C)C3C(O)CC(C)C13)C(=O)C(=C(C)C(C(CC)C)O)O2

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 378.509

InChIKey:
WZZIXUQLPGLEQW-UHFFFAOYSA-N

ID: 50

SMILES:
Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C(=O)O)CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 344.451

InChIKey:
YOVRGSHRZRJTLZ-UHFFFAOYSA-N

ID: 51

SMILES:
CC1C2=CC3C(C34C(C)CC2(C2=CC(=CC(C)(C)N)CO2)OC4=O)Oc2c1c(O)cc(CCCCC)c2

Pathway: Polyketides

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 505.655

InChIKey:
UGKDCGKVDQHXOP-UHFFFAOYSA-N

ID: 52

SMILES:
C1(c2c(O)cc(CCCC)cc2)C(C(C)C)CCC(C)=C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 286.459

InChIKey:
KVDBNLOKWYLSLD-UHFFFAOYSA-N

ID: 53

SMILES:
C1C(C)(C)C2C(C)(CC1)Oc1c(c(O)cc(CCCCC)c1)C2

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 316.485

InChIKey:
KPTGTVLDBMVBEX-UHFFFAOYSA-N

ID: 54

SMILES:
O=C1C(c2c(C(=O)O)cc(CCCCC)cc2O)OC(C)(C)CC1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 334.412

InChIKey:
LCKNAKLEZVDFCR-UHFFFAOYSA-N

ID: 55

SMILES:
O=C1c2c(O)cc(CCCCC)cc2C2C(O2)C2C(C)(C)CC21

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 314.425

InChIKey:
QKKJDSYNGJBWQT-UHFFFAOYSA-N

ID: 56

SMILES:
C(CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)CC(C)=CC2=C)O

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 356.506

InChIKey:
FFPHERDWTNEKJY-UHFFFAOYSA-N

ID: 57

SMILES:
CC1(CCC=C(C)C)C(Cc2c(O)c(OC(=O)C)cc(CCC)c2)C(C)CC(C)=C1

Pathway: Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 412.614

InChIKey:
VNLCCSFRFVEBAF-UHFFFAOYSA-N

ID: 58

SMILES:
C(CCCC)Cc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)(O)C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 344.495

InChIKey:
YYFRYOLDECBXLN-UHFFFAOYSA-N

ID: 59

SMILES:
C(c1cc(OC)c2c(c1)OC(C)(C)C1CCC(=C)CC21)CCC

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 314.469

InChIKey:
ZJGZRASSVXZFIX-UHFFFAOYSA-N

ID: 60

SMILES:
C(CCC)Cc1cc(O)c2c(c1O)C1C(C(C)(C)O2)CC=C(C)C1

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 330.468

InChIKey:
GEEMMNOKGSQDQI-UHFFFAOYSA-N

ID: 61

SMILES:
CCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 300.442

InChIKey:
RVWTXSLOGRTPEH-UHFFFAOYSA-N

ID: 62

SMILES:
CC(C(=O)c1c(O)c(C=O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1)C

Pathway: Polyketides;Terpenoids

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 342.435

InChIKey:
JSPFAESXEAXJNK-UHFFFAOYSA-N

ID: 63

SMILES:
CC1c2c(cc(C)c(O)c2)-c2c(cc(CCCCC)cc2O)O1

Pathway: Polyketides

Superclass: Meroterpenoids

Class: Cannabinoids

MW: 312.409

InChIKey:
OHDXBYOMIKYWHS-UHFFFAOYSA-N

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