ID: 112603
SMILES:c1(OC)c(C2C=C(C)C(O)CC2C(C)=C)c(O)ccc1C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.841
InChIKey:DHXDAPFLJZLNIR-UHFFFAOYSA-N
ID: 112604
SMILES:C(C(=C1CCC(C)=CCc2c(O)cc(CCCCC)cc2O1)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.687
InChIKey:PVKMFEVGFHMKHO-UHFFFAOYSA-N
ID: 112605
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(C=C)C(OC(=O)C)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.402
InChIKey:SILSBWBSNHOTPC-UHFFFAOYSA-N
ID: 112606
SMILES:C(=O)(OC1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C2(O)C(=C)CCCC2(C)C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -14.239
InChIKey:ZWWMXDFPQSFTRE-UHFFFAOYSA-N
ID: 112607
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)(O2)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.385
InChIKey:OEDPJGVWHANUAE-UHFFFAOYSA-N
ID: 112608
SMILES:C12=C(c3ccc(C)c4c3C=CC(C)(CC=C(C)C)O4)COC(C)(C)C1CCC(C)=CC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.604
CB1 binding score: -12.092
InChIKey:ATSSALZDPDRWLL-UHFFFAOYSA-N
ID: 112609
SMILES:C(CCCC)Cc1cc(O)c(CC=C(C)CCC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 398.631
CB1 binding score: -18.393
InChIKey:PHVGPKALUWIASL-UHFFFAOYSA-N
ID: 112610
SMILES:c1c(OC(=O)C)cc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.142
InChIKey:BOKSXUVCNMISJY-UHFFFAOYSA-N
ID: 112611
SMILES:C(=CCCC(C)=CCc1c(O)cc(CC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 112612
SMILES:COc1c(O)c(CC=C(C)CCC=C(C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.615
InChIKey:RBAMEMWAPDBZPD-UHFFFAOYSA-N
ID: 112613
SMILES:c1(C(C2CC(C)=C3CCC(C)=CC3C2(C)C)C)cc(CCC(CC)C(=C)C)cc(OC)c1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -11.728
InChIKey:FASSVPOLOXEGHO-UHFFFAOYSA-N
ID: 112614
SMILES:Oc1c(C2C(C(C)=C)CC(=O)C(C)=C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -18.451
InChIKey:YKQFRQCMTDTORX-UHFFFAOYSA-N
ID: 112615
SMILES:C(OC1C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C1C2)=Cc1ccc(O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -15.047
InChIKey:RACQWUBPZZZFMR-UHFFFAOYSA-N
ID: 112616
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 112617
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)(C(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.847
InChIKey:QEPWXQNGEBSQFI-UHFFFAOYSA-N
ID: 112618
SMILES:C(CCCCCCCCC)c1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.902
InChIKey:JMAAEPKTKGIVGH-UHFFFAOYSA-N
ID: 112619
SMILES:C(CC(C)=CCCC1(C)Oc2c(O)cc(CCCCC)cc2C=C1)CC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.006
InChIKey:NPHXKVHXSGQRPC-UHFFFAOYSA-N
ID: 112620
SMILES:O1c2cc(CCCCC)cc(OC)c2C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 112621
SMILES:c1(OC)c(OC)c(OC)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.502
InChIKey:MZIZMOBUXOQISS-UHFFFAOYSA-N
ID: 112622
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 112623
SMILES:CC(O)(CCC(CC=C(CCC=C(C)C)C)C)C1COc2cc(CCCCC)ccc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.685
CB1 binding score: -12.432
InChIKey:PFGJLWHMSOGULV-UHFFFAOYSA-N