ID: 96958
SMILES:C1(O)C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.072
InChIKey:DJCKLUPKZRLTPE-UHFFFAOYSA-N
ID: 96959
SMILES:C1(C)C2C(c3c(O)cc(CCCCC)cc3O2)OC(C=C(CCC=C(C(=O)O)C)C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.465
InChIKey:PSSZHMSPDAMWLK-UHFFFAOYSA-N
ID: 96960
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 96961
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1(O2)CCC(=C)C2CC(=O)C(C)=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.54
InChIKey:AJHXNNOUSCFGFJ-UHFFFAOYSA-N
ID: 96962
SMILES:c1c2c(c(CCC)cc1O)OC(C)(C)C1=C2C(=O)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.792
InChIKey:MVCLLHATBBOOBH-UHFFFAOYSA-N
ID: 96963
SMILES:c12c(ccc(CCCCC)c1)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.527
InChIKey:DCGMXMYHOPVUTO-UHFFFAOYSA-N
ID: 96964
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2CC3(C)CCC(O)C13CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.253
InChIKey:CGGQSLVNZPEQJE-UHFFFAOYSA-N
ID: 96965
SMILES:c1(CCCC)cc2c(c(O)c1)C1CC(C(=O)O)C3C(C1=C(C)C(=O)O3)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.929
InChIKey:FBYZURODHGTXFZ-UHFFFAOYSA-N
ID: 96966
SMILES:CC(=CCCC(CO)=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 372.549
CB1 binding score: -16.608
InChIKey:KNTBIJBDUUFKKL-UHFFFAOYSA-N
ID: 96967
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC1(C)OC2CCC(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -16.157
InChIKey:SEGOSBBBMCHMOZ-UHFFFAOYSA-N
ID: 96968
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 96969
SMILES:O=C1C(=C(C(C)C)OC(=O)C)C(=O)c2c(O)c3c(c(C)c21)C1C(C(C)(C)O3)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.52
CB1 binding score: -14.812
InChIKey:WUJGZWNOJOEKSV-UHFFFAOYSA-N
ID: 96970
SMILES:C1C2C(C)(OC(=O)C2C)CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C(O)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.292
InChIKey:UVSXAMRWGLBRAG-UHFFFAOYSA-N
ID: 96971
SMILES:C1=C(C(C)C)CCC2(C)C1c1c(cc(CCCCC)c(C(=O)O)c1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.276
InChIKey:SUXKUFVLESUASG-UHFFFAOYSA-N
ID: 96972
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 96973
SMILES:c1(O)c2c(cc(C)c1)OC(CCCC(C)CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.02
InChIKey:RJPFOAKSSZMZDF-UHFFFAOYSA-N
ID: 96974
SMILES:C1CC2(C)OC1c1c(cc(CCCCC)cc1O)OC2C(O)C(C)c1ccccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.873
InChIKey:BVATYPSMQZFCRG-UHFFFAOYSA-N
ID: 96975
SMILES:Cc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.752
InChIKey:ZXXLPLVPOBSLTA-UHFFFAOYSA-N
ID: 96976
SMILES:CC(=O)Oc1c2c(cc(CCCCC)c1)OC(CCC=C(CO)C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.711
InChIKey:AHWLKFOYMIVLQY-UHFFFAOYSA-N
ID: 96977
SMILES:O(C)C(c1c(O)c2c(cc1CCCCC)OC(CO)(C)C2=O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.357
CB1 binding score: -15.929
InChIKey:YOBPMSYNGOJIGJ-UHFFFAOYSA-N
ID: 96978
SMILES:c1(O)cc(CCCCC)cc(O)c1CC1=C(C)CCC2C(C)(C)CCCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -18.507
InChIKey:LSPISRHAFRWXNY-UHFFFAOYSA-N