ID: 36415
SMILES:C1(C)=C2OC(c3c(CCCCC)cc(OC)cc3O)OC2CC(C)=CCC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -12.101
InChIKey:ICNCELLPGNPZQI-UHFFFAOYSA-N
ID: 36416
SMILES:C(CC(C)=CCCC(C)=CCc1c(O)cc(CCc2ccc(O)c(O)c2)cc1OC)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -15.786
InChIKey:MFIYMZNGNHTDCY-UHFFFAOYSA-N
ID: 36417
SMILES:C1CC2C(C)(C)Oc3c(c(O)c(C(OC)=O)c(CCCCC)c3O)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.464
InChIKey:GZGMXTAEOPOWLR-UHFFFAOYSA-N
ID: 36418
SMILES:c12c(cc(OC)c(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.334
InChIKey:YHJDVXSICIKMSR-UHFFFAOYSA-N
ID: 36419
SMILES:CC(C1=CC2=C(C)CCC2c2c(OC)cc(CCCCC)cc21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -16.558
InChIKey:DQAOBCLHIRJBHK-UHFFFAOYSA-N
ID: 36420
SMILES:CCOc1c(C(=O)OCCc2cc(O)c(O)cc2)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)C(OC(C)=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.582
CB1 binding score: -17.435
InChIKey:FXZPMNFGAWWTHZ-UHFFFAOYSA-N
ID: 36421
SMILES:C12(O)C=C(C)CC1c1c(O)cc(CCCCC)cc1OC2(C=C1C=C(C)C(=O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.51
CB1 binding score: -15.383
InChIKey:NQHZAMHDNTYECS-UHFFFAOYSA-N
ID: 36422
SMILES:C1(C)=CC2C(CC1=O)C(C)(C)Oc1c2cccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.317
CB1 binding score: -16.423
InChIKey:TXOQUJHOBROPSU-UHFFFAOYSA-N
ID: 36423
SMILES:C1(C)(CCC=C(C)C)C=Cc2c(cc(CCC)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 36424
SMILES:C1(=O)c2c(CCCCC)cc(O)cc2OC(C)(CCC=C(C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.361
InChIKey:NRDWIYFOWUUQDH-UHFFFAOYSA-N
ID: 36425
SMILES:O1c2c(c(O)c(C(OC)=O)c(CCCCC)c2)C2CC(C)(O)CCC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.505
InChIKey:OMEINXSPMQSOGT-UHFFFAOYSA-N
ID: 36426
SMILES:NCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.417
CB1 binding score: -15.434
InChIKey:KHXJNUWKGOEJPA-UHFFFAOYSA-N
ID: 36427
SMILES:O1C(C)(C)C2C(c3c(O)cc(CCC)cc3O1)CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.19
InChIKey:IYWFRXFDWNBEFG-UHFFFAOYSA-N
ID: 36428
SMILES:CC1C2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 36429
SMILES:C1(C)(CCC2=C(C)CCCC2(C)CO)C=Cc2c(c(C)cc(OC)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: Not available
InChIKey:JUGGFJKFGALENY-UHFFFAOYSA-N
ID: 36430
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2OC2OC(CO)C(O)C(O)C2O)C(CCC=C(C)C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.718
CB1 binding score: -14.84
InChIKey:VOAOBHXMUDIEDQ-UHFFFAOYSA-N
ID: 36431
SMILES:O1C23c4c(cc(CCCCC)cc4O)OC(C)(C)C1CCC3(C)CCC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.626
InChIKey:VPAOFYMPIONMAJ-UHFFFAOYSA-N
ID: 36432
SMILES:C1(OCC=C(C)CCC=C(C)C)Oc2c(cc(CCCCC)cc2O)C(O)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -15.616
InChIKey:VVCDGEAXMKXDAY-UHFFFAOYSA-N
ID: 36433
SMILES:c1c(O)ccc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.07
InChIKey:LIEZPCZOEMYUIR-UHFFFAOYSA-N
ID: 36434
SMILES:C1(C)(C)c2c(cc(C)cc2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 36435
SMILES:O=C(C)Oc1cc2c(c(C)c1)C(c1c(O)cc(C)c3c1CC1C(C)(O3)OC1(C)C)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.586
CB1 binding score: -13.3
InChIKey:HLQLTQKZIPFLAW-UHFFFAOYSA-N