ID: 90973
SMILES:CC1C(=C)C(c2c(O)ccc(CCCCC)c2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.097
InChIKey:FYXMTZBMHQPSFG-UHFFFAOYSA-N
ID: 90974
SMILES:C(C1(C)Oc2c(c(O)cc(CCCCC)c2)C2=C(C(C)(C)OC2=O)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.087
InChIKey:PJSRIJSZOSRGLC-UHFFFAOYSA-N
ID: 90975
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merohemiterpenoids
MW: 234.295
CB1 binding score: -18.753
InChIKey:CJTQUGOPLSKVPR-UHFFFAOYSA-N
ID: 90976
SMILES:C1CC(COC(C)=O)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.004
InChIKey:YPVOZBGNUFYCHV-UHFFFAOYSA-N
ID: 90977
SMILES:c1(CCCCC)cc2c(c(O)c1C=O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.076
InChIKey:XBESCWCNNPVKJC-UHFFFAOYSA-N
ID: 90978
SMILES:C12C3C(C(C)(C)Oc4cc(CCCCC)cc(O)c41)C2OC(=O)C3=CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.814
InChIKey:KGSHHDNZIODHBD-UHFFFAOYSA-N
ID: 90979
SMILES:O1Cc2cc(O)c3c(c21)C1C(C(C)(C)O3)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -14.677
InChIKey:HZTQFZAKYKWSMZ-UHFFFAOYSA-N
ID: 90980
SMILES:C1(CCC(=CCc2c(O)cc(C)cc2O)C)=CC(CO)(C)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.171
InChIKey:NEILFNPZSBTSJR-UHFFFAOYSA-N
ID: 90981
SMILES:c1c(CCCCC)ccc2c1C1C(C(C)(C)O2)CC=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.7
InChIKey:NZKGYEMRQJXQFJ-UHFFFAOYSA-N
ID: 90982
SMILES:C12=C(C)C3OC3CC13C(C)(CCCC3(C)C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.958
InChIKey:YZGNLLWJBKYHSX-UHFFFAOYSA-N
ID: 90983
SMILES:C(CCCCc1cc2c(c(OC)c1)OCO2)C(CC)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -15.052
InChIKey:KCZKNYRINGRMKO-UHFFFAOYSA-N
ID: 90984
SMILES:c1(O)c2c(cc(CCCCC)c1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.889
InChIKey:UQZHCXRAKGTLRR-UHFFFAOYSA-N
ID: 90985
SMILES:C1(C(C)(C)O)Oc2ccc(CCCCC)cc2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -17.951
InChIKey:QBJJHVAFGNJSIZ-UHFFFAOYSA-N
ID: 90986
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1OC(C)(C)OC1C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -13.751
InChIKey:TULZXTIKNKPUEN-UHFFFAOYSA-N
ID: 90987
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 90988
SMILES:c1(CCCC(C(C)O)OC)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: Not available
InChIKey:YEXUEOVUHXDWTE-UHFFFAOYSA-N
ID: 90989
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.088
InChIKey:BVFMWJRKEINFKX-UHFFFAOYSA-N
ID: 90990
SMILES:CC1(OC(=C)C)C(=O)C2c3c(O)cc(CCCCC)cc3OC(C2(C)C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.93
InChIKey:QGPODHKQSCMEDK-UHFFFAOYSA-N
ID: 90991
SMILES:C12C(C)(C)OOc3c(c(O)cc(CCCCC)c3)C1(O)C(=C(C(=O)O)C)CCC2CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.529
CB1 binding score: -14.455
InChIKey:NPYIQTMQAPOKIB-UHFFFAOYSA-N
ID: 90992
SMILES:C(CCCC)CCCCCCCCc1cc(O)c(C2C=C(C)CCC2C(C)(O)O)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.673
CB1 binding score: -16.671
InChIKey:MZXPYTUKFQYCID-UHFFFAOYSA-N
ID: 90993
SMILES:C1(=CO)C(O)C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -13.021
InChIKey:ZQUKXYYNPUZFQI-UHFFFAOYSA-N