ID: 109348
SMILES:c1(OC2(C(C)C)CCC(C)=CC2)c(O)cc(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.963
InChIKey:QLIALFDXDAFPJH-UHFFFAOYSA-N
ID: 109349
SMILES:O1c2c(c(O)c(C(OC)=O)c(CCCCC)c2)C2C1(C)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.221
InChIKey:VZNNHSRTAPJRHF-UHFFFAOYSA-N
ID: 109350
SMILES:Oc1c(CC=C(C)C)c(O)cc(C)c1C1C(C(C)=C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.67
InChIKey:RQBYUGZJKLGSHJ-UHFFFAOYSA-N
ID: 109351
SMILES:C1(CCC=C(C)C)(C)C2CCC3(C)OC3C2c2c(cc(CCCCC)cc2OC)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: Not available
InChIKey:SMCPEDVYFZGJFX-UHFFFAOYSA-N
ID: 109352
SMILES:NCCCc1cc2c(c(O)c1)C1CC(C(=C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -14.768
InChIKey:VZINLSIQFYELQU-UHFFFAOYSA-N
ID: 109353
SMILES:C1C2(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C(=O)C=C(OC)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.793
InChIKey:MYADAWBBVUCCMI-UHFFFAOYSA-N
ID: 109354
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 109355
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 109356
SMILES:C1C(C(C)=C)C(c2c(O)ccc(O)c2)CC(=C)CCC=C(COC(=O)CCC)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.957
InChIKey:HDGGLUREPJOORV-UHFFFAOYSA-N
ID: 109357
SMILES:c1c(O)c(CC=C(C)C)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.579
InChIKey:OYJXIBXDIWVTLP-UHFFFAOYSA-N
ID: 109358
SMILES:c1(O)ccc(C)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.537
InChIKey:CJMAOVBRHHQLTN-UHFFFAOYSA-N
ID: 109359
SMILES:C1C(C(=C)C)C(c2c(CCCCC)cc(O)cc2O)C=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.645
InChIKey:QFBGUBAPLYNEFJ-UHFFFAOYSA-N
ID: 109360
SMILES:O=C(c1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c(CC=C(CCC=C(C)C)C)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -13.524
InChIKey:XWUHLPHUBSWCEN-UHFFFAOYSA-N
ID: 109361
SMILES:c1(CCCCC)c(C(O)=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N
ID: 109362
SMILES:C(C)(=C)C1Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.972
InChIKey:PNTUMNSXROGTBL-UHFFFAOYSA-N
ID: 109363
SMILES:CCc1cc(O)c(O)c2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.666
InChIKey:WKUJIDIGQFTORY-UHFFFAOYSA-N
ID: 109364
SMILES:C(c1cc(C(O)C(C=C)C)cc(C2C(C(C)=C)C(c3cc(CCCCC)cc(O)c3)C=C(C)C2)c1)(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.766
CB1 binding score: -15.802
InChIKey:NAKPUJYEDYBQDC-UHFFFAOYSA-N
ID: 109365
SMILES:C=C1C(=O)C2c3c(OC)cc(CCCCC)cc3OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.787
InChIKey:WWLIVRXSCBORDS-UHFFFAOYSA-N
ID: 109366
SMILES:C=C(C)C1Cc2c(cc(CCCBr)cc2OC)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 325.246
CB1 binding score: -15.374
InChIKey:FTJWRCYDCSOVFQ-UHFFFAOYSA-N
ID: 109367
SMILES:c1c2c(c(OC)c(O)c1C(C)O)OC(C)(CCC=C(C)C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.346
InChIKey:AASOSPNYLARADS-UHFFFAOYSA-N
ID: 109368
SMILES:Cc1c(O)c(C2C=C(C)CCC2C(C)=C)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.818
InChIKey:XDCTXCNIBNYTPQ-UHFFFAOYSA-N