ID: 104056
SMILES:C12(C(C)(C)O)C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.545
InChIKey:MVOYRZTZLZAOEB-UHFFFAOYSA-N
ID: 104057
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 104058
SMILES:CC(=CCCC(C)=CCCC(=CCc1c(O)c(C2C=C(C)CCC2C(C)C)c(O)cc1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -18.878
InChIKey:FFUOIIAZJYKITL-UHFFFAOYSA-N
ID: 104059
SMILES:c1(CC(C)C)cc(C(O)=O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.381
InChIKey:RULBVYHTVCHTFX-UHFFFAOYSA-N
ID: 104060
SMILES:C12(O)CC(C)(C)CC1C(O)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -14.4
InChIKey:CFDILAKVYHKAOU-UHFFFAOYSA-N
ID: 104061
SMILES:CCCc1cc(O)c2c(c1)OC1(C)CCCC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 288.431
CB1 binding score: -18.4
InChIKey:IYJFZOBKCYBWAD-UHFFFAOYSA-N
ID: 104062
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(ccc(CCC(O)CC)c1)CC1=C(C)C(OC)OC(OC)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -14.407
InChIKey:NDBRSPRHPGPNGI-UHFFFAOYSA-N
ID: 104063
SMILES:Oc1cc(CC2C(C)(C)OC3C2(C)C(C(=C)OCC)C=C(C)CC3)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.157
InChIKey:NMEYABBYPYVFQD-UHFFFAOYSA-N
ID: 104064
SMILES:CC(C1CC2C(C)(CC1)Oc1cc(CCCCC)cc(O)c12)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -16.998
InChIKey:RGSONOFIXDPWHK-UHFFFAOYSA-N
ID: 104065
SMILES:C(c1cc(O)c(CC=C(CCCC(C)=CC(C=C(C)C)=O)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.781
InChIKey:CXBPQQFCEACFIH-UHFFFAOYSA-N
ID: 104066
SMILES:C1(C)(C)Oc2c(cc3c(c2)OC(C)(CCC=C(C)C)C=C3)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.014
InChIKey:SRYNHRHXIKFWFS-UHFFFAOYSA-N
ID: 104067
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(C(=O)O)c(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.334
InChIKey:IBMAVYDRRHOYLE-UHFFFAOYSA-N
ID: 104068
SMILES:c1(CC(C)=O)cc(OCC=C(C)C)cc2c1OC1(C)C(C2)C(C(CCC(O)C(O)(C)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -12.742
InChIKey:GYXACGXTKHPOFS-UHFFFAOYSA-N
ID: 104069
SMILES:C(C)Cc1cc(O)c(C2C=C(CO)CC(O)C2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.929
InChIKey:ORWFBWFIMLPTIT-UHFFFAOYSA-N
ID: 104070
SMILES:C1CC(C=O)=CC2C1C(C)(C)Oc1c2cc(O)c(C(=O)CCCCCCCCCCCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.732
CB1 binding score: -16.514
InChIKey:KPIJTMNHRUMEGV-UHFFFAOYSA-N
ID: 104071
SMILES:CC1(C)C2CC=C(CO)CC2c2c(Br)cccc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 323.23
CB1 binding score: -14.263
InChIKey:GNGZZTZVBPHROY-UHFFFAOYSA-N
ID: 104072
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)CC=C2CC(C)(C)CCC12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.983
InChIKey:WZDPYGINTGOADR-UHFFFAOYSA-N
ID: 104073
SMILES:c1(CCCC(=O)C)cc(O)c(CC=C(CCC=C(C)C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.015
InChIKey:QRMVBNYSLITMOR-UHFFFAOYSA-N
ID: 104074
SMILES:CC1(C)C2CCC(C)=CC2c2c(cccc2C(O)=O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -16.769
InChIKey:FAQFXBKIJXNDII-UHFFFAOYSA-N
ID: 104075
SMILES:C12CCCC1(C)c1c(cc(C)cc1O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.064
InChIKey:BSWGLBUIISKILG-UHFFFAOYSA-N
ID: 104076
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N