ID: 60166
SMILES:c12cc(CCCCC)cc(O)c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 60167
SMILES:Cc1cc(C2C(C(=C)C)CCC(C)=C2)c(O)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.929
InChIKey:MSVOHXPRFARWQY-UHFFFAOYSA-N
ID: 60168
SMILES:C1C2C(C)(C)Oc3cc(O)cc(CCCCCC)c3C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.079
InChIKey:FVXUKMWDZVAGHZ-UHFFFAOYSA-N
ID: 60169
SMILES:C1(=O)C2(C)CC(O)C(C)=CCCC(C)=CCC(C(=C)C)C2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -15.769
InChIKey:IEJYFDCXDCQCCP-UHFFFAOYSA-N
ID: 60170
SMILES:C1=C(C)CC2(O)C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.751
InChIKey:UOSWLQIIJRKKSU-UHFFFAOYSA-N
ID: 60171
SMILES:C1(C(C)=C)CCC(C)(Oc2cc(CCCCCCC)cc(O)c2O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -14.79
InChIKey:GEWINADSQJTCIU-UHFFFAOYSA-N
ID: 60172
SMILES:c1(CC=C(C)C)c(O)c2c(cc1OC)OC(C)(C)C1C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.403
InChIKey:XZHHDUNKAVZFFK-UHFFFAOYSA-N
ID: 60173
SMILES:C(C(C1CCC(C)=CC1c1c(O)cc(CC)cc1)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -14.453
InChIKey:OPXYRMFAWYENHD-UHFFFAOYSA-N
ID: 60174
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C=O)CCC1(C)C2)C1C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.805
InChIKey:NJZJKBHZWKLCQV-UHFFFAOYSA-N
ID: 60175
SMILES:C(CCC)CCc1c(O)cc(O)c2c1OC1(C)CC=C(C(C)C)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.021
InChIKey:LRRSLRMOGKXIRW-UHFFFAOYSA-N
ID: 60176
SMILES:C(CCC)Cc1cc2c(c(O)c1)OC(CCC1(C)CCC=C(C)C1C)C(C)=CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.796
InChIKey:MJUZODXXXYRVNW-UHFFFAOYSA-N
ID: 60177
SMILES:CC(=O)OCC12CC(C)(C)C3CC1c1c(cc(CCCCC)cc1O)C(CO)=C2CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.67
InChIKey:BYUHKKWTUUNMJP-UHFFFAOYSA-N
ID: 60178
SMILES:CC(C)=CC1c2c(O)cc(C)c3c2C(C(C)(C)O3)CC1C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.963
InChIKey:TXCJJCVYLOCISB-UHFFFAOYSA-N
ID: 60179
SMILES:c1c(C)c2c3c(c1O)C(=O)C(CCC(C)=O)(O3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.547
InChIKey:UUBGKIYGSAZFCC-UHFFFAOYSA-N
ID: 60180
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC=C(C)CCC=C(C)C)(C)C(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.234
InChIKey:HMDRIQONNZKATN-UHFFFAOYSA-N
ID: 60181
SMILES:C(C(=O)c1c(O)c2c(cc1OC)OC(C)(C)C1CCC(C)=CC12)C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -12.302
InChIKey:PJLLAFMEVOWFEX-UHFFFAOYSA-N
ID: 60182
SMILES:CCCCc1c(O)c2c3c(c1O)OC(C)(C)C1C3C(CC2)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.526
InChIKey:PLUOLWFGIZGFKS-UHFFFAOYSA-N
ID: 60183
SMILES:C1(C)(C)C2C(C)(CCC1)Oc1cc(O)cc(CCCCC)c1C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.527
InChIKey:FSSNFCYISITYAB-UHFFFAOYSA-N
ID: 60184
SMILES:c12c(ccc(C)c1)C(C)(C)Oc1cc(CCCCCC)c(C(C(O)(CC)C)=O)c(O)c1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -16.353
InChIKey:FQKULLMEOITMSD-UHFFFAOYSA-N
ID: 60185
SMILES:CC12CCC(Br)C(C)(C)OC13Oc1c(c(O)cc(CCCCC)c1)C3C=C(C)CCC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 507.509
CB1 binding score: -12.723
InChIKey:NLBJWKVGELAHHA-UHFFFAOYSA-N
ID: 60186
SMILES:C(CC1CC(COC(C)=O)CCC1C(=C)CCC=C(Cc1cc(CCc2ccccc2)cc(O)c1)C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.777
CB1 binding score: -12.992
InChIKey:LHGQOZMCNKORMF-UHFFFAOYSA-N