ID: 41098
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 41099
SMILES:C(CCCC)c1cc(O)c(C2C(C(=C)C)CCC(C)(O)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 41100
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 41101
SMILES:C(C)(=CCCC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C(=O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.334
InChIKey:WINCRFZOLLUXNL-UHFFFAOYSA-N
ID: 41102
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 41103
SMILES:C1(C)=CC2C(CCC(C)=CCC1)C(C)(C)Oc1c2c(O)c(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -13.749
InChIKey:HGNPMOQOKGICEO-UHFFFAOYSA-N
ID: 41104
SMILES:c1c(C=O)c(O)c2c(c1C1(C)C(C)CC(=O)C1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -16.278
InChIKey:KBYXVNNGKFTJJO-UHFFFAOYSA-N
ID: 41105
SMILES:c1c(CCCCC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 41106
SMILES:OC(O)C(c1c(OC(=O)C)c(C(CCC)=O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -14.469
InChIKey:WJVMGNIMOCFZQJ-UHFFFAOYSA-N
ID: 41107
SMILES:CC(C(N(CCOc1c2c(cc(CCCC)c1)OC(C)(C)C1CCC(C)=CC1C2)CCC(C)C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 497.764
CB1 binding score: -13.269
InChIKey:WQDKGJUHNWKAGU-UHFFFAOYSA-N
ID: 41108
SMILES:Oc1cc(C(C(CC)C)=O)c(O)c2c1OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.913
InChIKey:RVMGTNGTRLGABR-UHFFFAOYSA-N
ID: 41109
SMILES:C1C(O)C2(C)OC1c1c(ccc(CCCCC)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.521
InChIKey:DQVNPLGIRRDLOW-UHFFFAOYSA-N
ID: 41110
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(O)(C)CCC2C(C)=C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.987
InChIKey:JIEZEFRFOTXWHY-UHFFFAOYSA-N
ID: 41111
SMILES:c1(CC)cc(OC)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -16.547
InChIKey:UJJSJDDICOWJAH-UHFFFAOYSA-N
ID: 41112
SMILES:COc1cc(CCCC)cc2c1C1(C(=O)OC)C(CC(C)CCC1)C2(CCCC(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.684
CB1 binding score: -15.195
InChIKey:SCZIAIBVXNNGFX-UHFFFAOYSA-N
ID: 41113
SMILES:CC(C1CCC2(C)Oc3c(c(O)cc(CCCCCCCC)c3)C2C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -14.2
InChIKey:WKTQTKZTJTYYTI-UHFFFAOYSA-N
ID: 41114
SMILES:c1(C2C=C(C)CCC2C(=C)C)ccc(OCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -16.597
InChIKey:LSXMWLSHIWIKOG-UHFFFAOYSA-N
ID: 41115
SMILES:C(C)(C)=CC1c2c(cc(CCCCC)cc2O)OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.334
InChIKey:LKJNAKRLOPZHAJ-UHFFFAOYSA-N
ID: 41116
SMILES:c1cc2c(cc1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -17.752
InChIKey:CJFQORFGFVBCSD-UHFFFAOYSA-N
ID: 41117
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 41118
SMILES:C1C2=C(OC(C)(C)C3C1(C)C(C)C(O)(CO)C3)C(=O)C(C(=O)C(CC)C)=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.57
InChIKey:BDMXNIOAPCCVPD-UHFFFAOYSA-N