ID: 62098
SMILES:C(C)(C)C1CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.855
InChIKey:VBMSTUJNROPVAW-UHFFFAOYSA-N
ID: 62099
SMILES:c1c(O)c(CC=C(CCC=C(C)C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 62100
SMILES:c12c(c(O)cc(CCCCC)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: 62101
SMILES:C(Cc1cc(OCCCCC)cc(C2(C)C(C)=CCCC2C)c1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.578
CB1 binding score: -14.886
InChIKey:DEVBDVTUKVHXEH-UHFFFAOYSA-N
ID: 62102
SMILES:C1CC2(C)CCCC3(C)C1(OO2)c1c(cc(CCCCC)cc1O)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.339
InChIKey:YRLGGMLZSMEBMZ-UHFFFAOYSA-N
ID: 62103
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)C(O)CC1=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.153
InChIKey:IDLSOAPWANSCDZ-UHFFFAOYSA-N
ID: 62104
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C1C=C(C(C)C)CCC1(O)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.78
InChIKey:RBTLDTLKVOVEOJ-UHFFFAOYSA-N
ID: 62105
SMILES:CC(O)C12Oc3c(c(O)cc(CCCCC)c3)C(O1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -14.685
InChIKey:BFCBHWKVCJKWMR-UHFFFAOYSA-N
ID: 62106
SMILES:c1(CCC)cc2c(cc1O)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.438
InChIKey:PBOBXVWDOCMHEM-UHFFFAOYSA-N
ID: 62107
SMILES:Cc1c(C(=O)OCCc2ccc(OC)cc2)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.548
CB1 binding score: -16.115
InChIKey:VBXHDQFNRXKHSO-UHFFFAOYSA-N
ID: 62108
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 62109
SMILES:C1=C(C)C2(CC2)C(C)(C)Oc2cc(CCCCC)c(C(OC)=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.722
InChIKey:AMLBLWFCVAWIIY-UHFFFAOYSA-N
ID: 62110
SMILES:COCc1c(C2C(C(=C)C)CC(O)C(C)=C2)c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.502
InChIKey:DJKKXQWICBQAHB-UHFFFAOYSA-N
ID: 62111
SMILES:Cc1ccc2c(c1)OC(C)(C)C(CC(O)C(C)=CC=CC(CCCCCCC)C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -16.283
InChIKey:DUMCSXVVBOUTLF-UHFFFAOYSA-N
ID: 62112
SMILES:CC1(C)Oc2cc3c(c(C(=O)C(CC)C)c2O)OC(C)(C)C2=C(C(CC2)C(C)(C)O1)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -13.17
InChIKey:SRGLNXBAWURAPJ-UHFFFAOYSA-N
ID: 62113
SMILES:c1c(O)cc(CCCCC)c(C2C(C(C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.855
InChIKey:ZWHZXURSOJBUAW-UHFFFAOYSA-N
ID: 62114
SMILES:C(C)(c1c2c(O)cc(CCCCC)cc2c(O)c(CC=C(C)C)c1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -13.39
InChIKey:PXDDYEDCVVJLIF-UHFFFAOYSA-N
ID: 62115
SMILES:O(C)c1cc(CCCCC)cc(O)c1C1C(C(CO)C)CCC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.526
CB1 binding score: -16.36
InChIKey:CNCDMLPSRUHFDY-UHFFFAOYSA-N
ID: 62116
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 62117
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(CCC=C(C)C)(O)C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.786
InChIKey:DEFGNEJWMYOSDR-UHFFFAOYSA-N
ID: 62118
SMILES:O(C)c1cc(OC)c(OC)c2c1-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.886
InChIKey:DPJLAXDUHLXNMI-UHFFFAOYSA-N