ID: 83119
SMILES:c1(CCCCC)cc(OC)c2c(c1OC(C)=O)OC1(C)CC=C(C(CCCC(C)C)C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -17.526
InChIKey:IYYBMBXWUNXNRF-UHFFFAOYSA-N
ID: 83120
SMILES:OC(=O)C1=CCC2C(C)(C)CCCC2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.376
InChIKey:NYSAALAXCSKSFR-UHFFFAOYSA-N
ID: 83121
SMILES:c1(O)c(C2(OC)C=C(C)CC2)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.436
InChIKey:JLKGTLJIKDGZRH-UHFFFAOYSA-N
ID: 83122
SMILES:c1(OC)cc(OC)c(Cl)c2cc3c(cc21)OC(C)(C)C1CCC(C)=CC31
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.892
CB1 binding score: -14.896
InChIKey:AEIYHWLYQOIERV-UHFFFAOYSA-N
ID: 83123
SMILES:C(CCC1(C)C2=C(C3C(CC2OC(C)=O)C(C)(C)OC(=O)C=C3)C(=O)O1)(O)C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.501
CB1 binding score: -14.657
InChIKey:QSPUUMRAFTXVMJ-UHFFFAOYSA-N
ID: 83124
SMILES:C(c1cc(O)cc(C2C=C(C)CCC2C(=C)C)c1O)=CC(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.98
InChIKey:NOKPNVIPOSSGJS-UHFFFAOYSA-N
ID: 83125
SMILES:c1cc2c3c(c1C)OC(C)(C)C1SC1C(=O)C3C(CC)C2C(C(C)=CC)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.541
CB1 binding score: -15.464
InChIKey:ZERIPVMOEWLNJU-UHFFFAOYSA-N
ID: 83126
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC3C(=C)CCC1C(C)(C3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.012
InChIKey:GGYMTQUPHCBAKT-UHFFFAOYSA-N
ID: 83127
SMILES:CC1(C)C2CCC(CO)=CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 83128
SMILES:C12C(=Cc3c(cc(C)cc3OC)C(=O)C1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -16.739
InChIKey:HSNSZSJMGPMXDB-UHFFFAOYSA-N
ID: 83129
SMILES:c1(CCCCC)cc2c(cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.041
InChIKey:UMOQSYCBNIIJKH-UHFFFAOYSA-N
ID: 83130
SMILES:O=C(OC1C2(C)C(=CC(=O)C1)C(O)c1c(O)cc(CCCCC)cc1O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -14.389
InChIKey:DEICQJUSDDVXIS-UHFFFAOYSA-N
ID: 83131
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)c(O)c2)C(C(CCC=C(C)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -17.473
InChIKey:LWLJOCKRRWGNCO-UHFFFAOYSA-N
ID: 83132
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3c(cccc3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.318
CB1 binding score: -16.822
InChIKey:DMWVASKIZHYTIO-UHFFFAOYSA-N
ID: 83133
SMILES:c12c(c(O)cc(C)c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.792
InChIKey:CYTXEQAJNPZCEA-UHFFFAOYSA-N
ID: 83134
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 83135
SMILES:Oc1c(C(C(CC)C)=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 83136
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 83137
SMILES:C1(=C(C)C)OC2C(C)(C1)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.317
InChIKey:LBRKYBIETQDTOA-UHFFFAOYSA-N
ID: 83138
SMILES:CC1(O)C2C(CC(C)=CC2)c2c(O)c(C(OC)=O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.43
InChIKey:UCXDOSROLKDFAY-UHFFFAOYSA-N
ID: 83139
SMILES:CC(C)=CC(=O)CC(=CCc1c(O)cc(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.526
InChIKey:XCLRFWVIRYZONF-UHFFFAOYSA-N