ID: 133372
SMILES:O1C(C)(C)C2C(C=C(C)CC2)c2c1cccc2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 133373
SMILES:c1(C2C(C(C)C)CCC(C)(O)C2)c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.527
CB1 binding score: -16.213
InChIKey:DZTXSEIFUHUSSA-UHFFFAOYSA-N
ID: 133374
SMILES:CC(C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 133375
SMILES:C(CCCC)Cc1cc(O)c(C2C(C(C)(C)O)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.731
InChIKey:OIGIORMGYBQUCC-UHFFFAOYSA-N
ID: 133376
SMILES:c12c(c(O)cc(CCCCC)c1)C1=C(C(C)(C)O2)CC(O)C(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.555
InChIKey:WEVYNIJDEFFKLF-UHFFFAOYSA-N
ID: 133377
SMILES:C(C)(C)C1=CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.949
InChIKey:FZEZRVFOAQSQNI-UHFFFAOYSA-N
ID: 133378
SMILES:CC(=C)C(O)C1Oc2cc(CCCCC)cc(OC)c2C2C=C(C)C(=O)CC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -13.484
InChIKey:BBPZDJHJXYTLEJ-UHFFFAOYSA-N
ID: 133379
SMILES:c1c(C(C)C)c2c(cc1O)C1(O)C(C(C)(C)O2)CCC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.272
InChIKey:KHOIJVOJHZCGTI-UHFFFAOYSA-N
ID: 133380
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)c(Cl)c3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.914
CB1 binding score: -14.174
InChIKey:LNBFOHWTOMHWDL-UHFFFAOYSA-N
ID: 133381
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC3(C)CC=CC(C)(C)CC1=O)C(C)C2CCC3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -14.504
InChIKey:SDLDBAVHCAOOBG-UHFFFAOYSA-N
ID: 133382
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(OC(=O)C)c3C(CC(C)=CCC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -15.436
InChIKey:RDPHLIRVFMVLTB-UHFFFAOYSA-N
ID: 133383
SMILES:C1(c2c(O)cc(CCCCC)cc2O)CC(C)=C(C(=O)O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -14.818
InChIKey:OJYQNIQFIYVQEL-UHFFFAOYSA-N
ID: 133384
SMILES:c1c(C)cc(OC)cc1CCC(C1C(c2cc(O)c(C)c(CC=C(C)C)c2)CC(O)C(C)(CCC=C(C)C)C1C(=O)O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.845
CB1 binding score: -15.842
InChIKey:JFLITPWFAHENHP-UHFFFAOYSA-N
ID: 133385
SMILES:C(CC1(C)CCCC1(C)C)=CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -12.705
InChIKey:ALSMDUWKGIDERL-UHFFFAOYSA-N
ID: 133386
SMILES:CC1(C)Oc2cc(C(CC(C)C)=O)c(O)cc2C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.778
InChIKey:VIRDKRQJQUSTJH-UHFFFAOYSA-N
ID: 133387
SMILES:c12cc(CCCCC)cc(O)c1C1C(=C(C)CC(=O)CC1(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.39
InChIKey:HUQWXDPTVNUGAX-UHFFFAOYSA-N
ID: 133388
SMILES:c1(Br)cc(C)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -16.223
InChIKey:QIEDRCSTMJEKBQ-UHFFFAOYSA-N
ID: 133389
SMILES:C(CCC=C(C)C)(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 133390
SMILES:c12c(OC)cc(O)c(C(NCCc3ccc(O)cc3)=O)c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 437.536
CB1 binding score: -11.593
InChIKey:PNSOBGHFFFDHEB-UHFFFAOYSA-N
ID: 133391
SMILES:C12(C)CCC=C(C(O)=O)C1C1c3c(O)cc(C)cc3OC(C)(C)C(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.871
InChIKey:UHXWWTRVNICULA-UHFFFAOYSA-N
ID: 133392
SMILES:c1(C(C)C)c(O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.532
InChIKey:PKWLSGWYNRTTIK-UHFFFAOYSA-N