ID: 74488
SMILES:Oc1c(C(=O)C(CCCC)C)c2c(c(C=O)c1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 414.542
CB1 binding score: -16.929
InChIKey:IIZWAWBBGCXNKF-UHFFFAOYSA-N
ID: 74489
SMILES:Oc1c2c(cc(CCCCC)c1)C1C(C1(C)C)CC2C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.979
InChIKey:CLJNMFGVDNOYPF-UHFFFAOYSA-N
ID: 74490
SMILES:CC1=CCCC(C)=CCCC(C)(C)Oc2cc(O)cc(CCCCCC)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.998
InChIKey:OAOYMMXCJHXWMW-UHFFFAOYSA-N
ID: 74491
SMILES:CC1=CC(c2ccc(CCCCC)c(O)c2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.701
InChIKey:GLWWBCAZFMPOBS-UHFFFAOYSA-N
ID: 74492
SMILES:CC(=CCCC1=CCCC(C)=CCC=C(COC(=O)C)C(Cc2cc(O)cc(C)c2O)C1(C)CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.808
CB1 binding score: -16.665
InChIKey:UNLRMQKSCLZKRS-UHFFFAOYSA-N
ID: 74493
SMILES:c1(C2CCCC=C2)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(N=C=S)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 385.529
CB1 binding score: -13.004
InChIKey:SERZNPUXWFVHDB-UHFFFAOYSA-N
ID: 74494
SMILES:C(CCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C1CC2CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -14.589
InChIKey:GJSSDMMSKZFDQJ-UHFFFAOYSA-N
ID: 74495
SMILES:C1=CC(C(c2cc(OC)c(O)cc2)CC(=O)OC)OC1(C)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.649
CB1 binding score: -12.236
InChIKey:RYAMPZSEZNNMJQ-UHFFFAOYSA-N
ID: 74496
SMILES:C(CC)Cc1c(C2(C)CCC(C)=C(C)O2)c(O)c(C(O)=CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.729
InChIKey:IOZFBPJXYKNOKE-UHFFFAOYSA-N
ID: 74497
SMILES:O=Cc1c(O)c(C(O)CCCCC)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.811
InChIKey:NNYSFZHNTWGTNB-UHFFFAOYSA-N
ID: 74498
SMILES:C1C(C)=CC(c2ccc(CCCC)cc2)C(C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.46
CB1 binding score: -18.171
InChIKey:QBUIJIADVGCWQN-UHFFFAOYSA-N
ID: 74499
SMILES:CC1CC(=O)C(O)c2c1cc(O)c1c2OC(C)(C)C2CCC(O)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -14.845
InChIKey:LPNYKQXYDXMBFO-UHFFFAOYSA-N
ID: 74500
SMILES:C(C)CCCc1c(C(=O)O)c2c(cc1O)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -19.86
InChIKey:NVGIDLDWOQTBMF-UHFFFAOYSA-N
ID: 74501
SMILES:C1(=O)C(CCC=C(C(=O)O)C)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -15.278
InChIKey:UJVFEZOHOMYGBE-UHFFFAOYSA-N
ID: 74502
SMILES:c1(O)cc(CCCC)cc2c1C1CC(C)(O2)CCC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.903
InChIKey:DQIJFJFAQLIKDN-UHFFFAOYSA-N
ID: 74503
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 74504
SMILES:C(C(Br)(CCl)C)=Cc1cc(C2C=C(CCC=C(C)C)CCC2C(C)=C)c(O)c(CC=C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 562.032
CB1 binding score: -14.201
InChIKey:VIFPFVHKZJLGQY-UHFFFAOYSA-N
ID: 74505
SMILES:C1(C)=CC(c2c(O)cc(CCCC)cc2)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -17.81
InChIKey:KVDBNLOKWYLSLD-UHFFFAOYSA-N
ID: 74506
SMILES:C1CC(C)=CCOc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -13.971
InChIKey:AYYWNJRQBQCMPA-UHFFFAOYSA-N
ID: 74507
SMILES:C=CCCCc1cc2c(c(OC)c1)C=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.929
InChIKey:RHSUJOYNDREIBC-UHFFFAOYSA-N
ID: 74508
SMILES:C(C)(=O)OC1C=Cc2c(cc(CCCCC)cc2O)OC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -12.352
InChIKey:LNQKZKZRIGMXEL-UHFFFAOYSA-N